Molecule

ID:51552

General Information
Structure
MolImage
Molecular Formula
C₁₉H₃₁FN₂OSi
Molecular Mass
350.5461432
Exact Mass
350.21896837
Charge
0
InChI
InChI=1S/C19H31FN2OSi/c1-7-8-16-9-10-17(21-18(16)20)22-12-11-15(13-22)14-23-24(5,6)19(2,3)4/h7,9-10,15H,1,8,11-14H2,2-6H3
InChIKey
GHHPFVLQPIAZFW-UHFFFAOYSA-N
Canonic Smiles
C=CCc1ccc(nc1F)N1CCC(C1)CO[Si](C(C)(C)C)(C)C
Isomeric Smiles
c1(c(nc(cc1)N1CCC(C1)CO[Si](C(C)(C)C)(C)C)F)CC=C
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
5.5286975
LogD (pH = 7.4)
5.5287
Log P
5.5287
Molar Refractivity
97.8522
Polarizability
38.653572
Polar Surface Area
25.36
Rotatable Bonds
7
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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